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Ligand

Name1,7-dimethyl-8-phenyl-3H-purine-2,6-dione
Molecular formulaC13H12N4O2
IUPAC name1,7-dimethyl-8-phenyl-3H-purine-2,6-dione
Molecular weight256.265
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP1.0
SynonymsZINC339584
MolPort-002-799-251
AB-323/13887526
CHEMBL324138
1,7-dimethyl-8-phenyl-3,7-dihydro-1H-purine-2,6-dione
[ Show all ]
Inchi KeyDFJWFVNLYOQXIS-UHFFFAOYSA-N
Inchi IDInChI=1S/C13H12N4O2/c1-16-9-10(15-13(19)17(2)12(9)18)14-11(16)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,15,19)
PubChem CID822305
ChEMBLCHEMBL324138
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
58606Adenosine receptor A1P25099Adora1Rattus norvegicus (Rat)326
58607Adenosine receptor A2aP30543Adora2aRattus norvegicus (Rat)410
58605Adenosine receptor A2bQ60614Adora2bMus musculus (Mouse)332

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